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CIF Information Card
Information card for 1100715
1100714 << 1100715 >> 1100716Preview
|
Coordinates |
1100715.cif |
Structure parameters
| Formula | - C57 H58 N2 P4 W - |
| Calculated formula | - C57 H58 N2 P4 W - |
| Title of publication | Reduction Pathway of End-On Terminally Coordinated Dinitrogen. IV. Geometric, Electronic, and Vibrational Structure of a W(IV) Dialkylhydrazido Complex and Its Two-Electron-Reduced Derivative Undergoing N-N Cleavage upon Protonation |
| Authors of publication | Kay H. Horn; Natascha Böres; Nicolai Lehnert; Klaus Mersmann; Christian Näther; Gerhard Peters; Felix Tuczek |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2005 |
| Journal volume | 44 |
| Pages of publication | 3016 - 3030 |
| a | 12.6448 ± 0.0011 Å |
| b | 12.9364 ± 0.0012 Å |
| c | 16.7806 ± 0.0016 Å |
| α | 84.98 ± 0.011° |
| β | 76.41 ± 0.01° |
| γ | 67.177 ± 0.01° |
| Cell volume | 2459.2 ± 0.4 Å3 |
| Cell temperature | 180 ± 2 K |
| Ambient diffraction temperature | 180 ± 2 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P -1 |
| Hall symmetry space group | -P 1 |
| Residual factor for all reflections | 0.0599 |
| Residual factor for observed reflections | 0.0423 |
| Weighted residual factors for the observed reflections | 0.0922 |
| Weighted residual factors for all reflections included in the refinement | 0.0989 |
| Goodness-of-fit parameter for observed reflections | 1.006 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |